N,N-双(2,6-二甲苯)苝-3,4,9,10-四羧酸二酰亚胺
- 中文名称:
- N,N-双(2,6-二甲苯)苝-3,4,9,10-四羧酸二酰亚胺
- 中文别名:
- N,N-双(2,6-二甲苯)苝-3,4,9,10-四羧酸二酰亚胺;
PTCDI-C4;
N,N`-双(2,6-二甲苯基)芘-3,4,9,10-四羧酸二酰亚胺
- 英文名称:
- Anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetrone,2,9-bis(2,6-dimethylphenyl)-
- 英文别名:
- 2,9-Bis(2,6-dimethylphenyl)isoquinolino[4',5',6':6,5,10]anthra[2, 1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone;
N,N'-di(1-pentyl)perylene-3,4:9,10-bis(dicarboximid);
N,N inverted exclamation marka-Dipentyl-3,4,9,10-perylenedicarboximide;
2,9-dipropyl-anthra[2,1,9-def,6,5,10-d'e'f']diisoquinoline-1,3,8,10-tetraone;
2,9-Bis(2,6-dimethylphenyl)anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetraone;
N,N'-dipropyl-3,4:9,10-perylenebis(dicarboximide);
N,N'-bis(2,6-dimethylphenyl)-3,4,9,10-perylenetetracarboxylic diimide;
N,N'-Dipropylperylen-3,4:9,10-bis(dicarboximid);
N,N'-dipentyl-3,4,9,10-perylenetetracarboxylic diimide;
N,N'-Dipentylperylen-3,4:9,10-bis(dicarboximid);
N,N'-Dipentyl-3,4,9,10-perylenedicarboximide;
N,N'-di(1-propyl)perylene-3,4:9,10-bis(dicarboximid);
N,N'-bis-n-propyl-3,4,9,10-perylenetetracarboxdiimide;
N,N'-Di-n-propyl-3,4:9,10-perylentetracarboxyldiimid;
N,N'-Di(2,6-xylyl)perylen-3,4:9,10-bis(dicarboximid)
- CAS No.:
- 76372-76-4
- 分 子 式:
-
C40H26N2O4
- 分 子 量:
- 598.65
- 精确分子量:
- 598.18900
- PSA:
- 78.14000
- MDL:
- MFCD00134588
- BRN:
- 4626671
- InChI:
- The Key: NJOMGKAERDOZHP-UHFFFAOYSA-N3
- 分子结构式:
-

- SDS:
- 查看
N,N-双(2,6-二甲苯)苝-3,4,9,10-四羧酸二酰亚胺 物化性质
- 密度:
- 1.439g/cm3
- 熔点:
- >300ºC(lit.)
- 折射率:
- 1.821
N,N-双(2,6-二甲苯)苝-3,4,9,10-四羧酸二酰亚胺 安全信息
- WGK_Germany:
- 3
德国有关水污染物质的分类清单
- 安全说明:
- 22-24/25
N,N-双(2,6-二甲苯)苝-3,4,9,10-四羧酸二酰亚胺 分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值(XlogP):7.9
2.氢键供体数量:4
3.氢键受体数量:6
4.可旋转化学键数量:6
5.互变异构体数量:3
6.拓扑分子极性表面积133
7.重原子数量:48
8.表面电荷:0
9.复杂度:1140
10.同位素原子数量:0
11.确定原子立构中心数量:0
12.不确定原子立构中心数量:0
13.确定化学键立构中心数量:0
14.不确定化学键立构中心数量:0
15.共价键单元数量:1
N,N-双(2,6-二甲苯)苝-3,4,9,10-四羧酸二酰亚胺 上游产品